| SpectraBase Compound ID | 68SRMl5Ty6t |
|---|---|
| InChI | InChI=1S/C21H20/c1-4-10-18(11-5-1)16-17-21(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h2-3,6-10,12-16H,1,4-5,11H2 |
| InChIKey | OOIYXFAJEDPJRL-UHFFFAOYSA-N |
| Mol Weight | 272.39 g/mol |
| Molecular Formula | C21H20 |
| Exact Mass | 272.156501 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3YvRInIcjnZ |
|---|---|
| Name | (3-(Cyclohex-1-en-1-yl)propa-1,2-diene-1,1-diyl)dibenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.156500644 u |
| Formula | C21H20 |
| InChI | InChI=1S/C21H20/c1-4-10-18(11-5-1)16-17-21(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h2-3,6-10,12-16H,1,4-5,11H2 |
| InChIKey | OOIYXFAJEDPJRL-UHFFFAOYSA-N |
| Molecular Weight | 272.391 g/mol |
| SMILES | C(=C=CC1=CCCCC1)(C=1C=CC=CC1)C=1C=CC=CC1 |